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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 28-Feb-2021 | /GeomOpt_wB97XD M51 | Foscato, Marco | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RwB97XD | GEN | -3927.12298836; Eh | |||
 | 28-Feb-2021 | /GeomOpt_wB97XD M53 | Foscato, Marco | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RHF; RwB97XD | GENECP GEN | -3927.1196641; Eh | |||
 | 28-Feb-2021 | /GeomOpt_wB97XD M41 | Foscato, Marco | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RHF; RwB97XD | GENECP GEN | -3927.1019228; Eh | |||
 | 28-Feb-2021 | /GeomOpt_wB97XD M43 | Foscato, Marco | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RwB97XD | GEN | -3927.11676279; Eh | |||
 | 28-Feb-2021 | /GeomOpt_wB97XD M42 | Foscato, Marco | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RwB97XD | GEN | -3927.11061176; Eh | |||
 | 28-Feb-2021 | /GeomOpt_wB97XD M45 | Foscato, Marco | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RHF; RwB97XD | GENECP GEN | -3927.0982144; Eh | |||
 | 28-Feb-2021 | /GeomOpt_wB97XD M44 | Foscato, Marco | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RwB97XD | GEN | -3927.10072997; Eh | |||
 | 28-Feb-2021 | /GeomOpt_wB97XD M46 | Foscato, Marco | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RwB97XD | GEN | -3927.11053029; Eh | |||
 | 28-Feb-2021 | /GeomOpt_wB97XD M47 | Foscato, Marco | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RwB97XD | GEN | -3927.12185916; Eh | |||
 | 28-Feb-2021 | /GeomOpt_wB97XD M35 | Foscato, Marco | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | UwB97XD | GEN | -3880.68419829; Eh |
Results 41-50 of 88 (Search time: 0.003 seconds).